| Keyword(s): | Human Metabolites |
| Molecule Category | Free-form |
| EPA CompTox | DTXSID1065392 |
| InChI Key | BELZJFWUNQWBES-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C12H31N5 |
| Molecular Weight | 245.26 |
| AlogP | -0.77 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 5.0 |
| Number of Rotational Bond | 14.0 |
| Polar Surface Area | 88.13 |
| Heavy Atoms | 17.0 |
| Resources | Reference |
|---|---|
| CAS NUMBER | 13274-42-5 |
| NORMAN SUSDAT | |
| PubChem | 83290 |
| ChemSpider | 75152.0 |